3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0013 |
| Compound Name: | 3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 334.29 |
| Molecular Formula: | C18 H10 N2 O5 |
| Smiles: | C1Oc2ccc(cc2O1)c1nc(C2=Cc3ccccc3OC2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.744 |
| logD: | 3.744 |
| logSw: | -4.2744 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.681 |
| InChI Key: | RWSSGOXCKMHKCF-UHFFFAOYSA-N |